SCHEMBL9960965

SCHEMBL9960965

Cn1ccc(S(=O)(=O)N2CCC(n3cc(-c4cnn5c(-c6cccc(N(CC(F)(F)F)C(N)=O)c6)cnc5c4)cn3)CC2)n1

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
FGFR3 P22607 18/20 0.43
KDR P35968 11/20 0.43
FGFR1 P11362 2/20 0.39
PIM1 P11309 1/20 0.33
FLT3 P36888 1/20 0.33
KCNH2 Q12809 1/20 0.33
PIM3 Q86V86 1/20 0.33
PIM2 Q9P1W9 1/20 0.33

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL9950506 0.82 FGFR3 (0.65) FGFR3KDR
SCHEMBL9960972 0.81 KDR (0.44) FGFR3KDRFGFR1
SCHEMBL9960280 0.80 FGFR3 (0.51) FGFR3KDRFGFR1
SCHEMBL9960297 0.70 FGFR3 (0.37) FGFR3KDRFGFR1
SCHEMBL9949431 0.66 FGFR3 (0.62) FGFR3KDR
SCHEMBL9949821 0.66 FGFR3 (0.70) FGFR3KDR
SCHEMBL10177430 0.66 MAP3K7 (0.46) FGFR3KDRFGFR1
SCHEMBL9950054 0.65 KDR (0.70) FGFR3KDR
SCHEMBL9949658 0.65 KDR (0.67) FGFR3KDR
SCHEMBL10176117 0.65 MAP3K7 (0.46) FGFR3KDRFGFR1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2012088266-A2 SUBSTITUTED IMIDAZOPYRIDAZINES AND BENZIMIDAZOLES AS INHIBITORS OF FGFR3 INCYTE CORPORATION (US) 2012-06-28 WO claimed